4-[4-(dimethylamino)phenyl]-6-oxo-2-sulfanyl-1,6-dihydropyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-[4-(dimethylamino)phenyl]-6-oxo-2-sulfanyl-1,6-dihydropyrimidine-5-carbonitrile
4-[4-(dimethylamino)phenyl]-6-oxo-2-sulfanyl-1,6-dihydropyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | 8010-3621 |
| Compound Name: | 4-[4-(dimethylamino)phenyl]-6-oxo-2-sulfanyl-1,6-dihydropyrimidine-5-carbonitrile |
| Molecular Weight: | 272.33 |
| Molecular Formula: | C13 H12 N4 O S |
| Smiles: | CN(C)c1ccc(cc1)C1=C(C#N)C(NC(=N1)S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5057 |
| logD: | -1.7939 |
| logSw: | -2.1883 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.475 |
| InChI Key: | NZCHSGKDKQKDBL-UHFFFAOYSA-N |